2-propoxy-5-(3-pyridazin-4-yl-1H-1,2,4-triazol-5-yl)benzenecarbonitrile

Systemtic Name: 2-propoxy-5-(3-pyridazin-4-yl-1H-1,2,4-triazol-5-yl)benzenecarbonitrile Openeye Name: 2-propoxy-5-(3-pyridazin-4-yl-1H-1,2,4-triazol-5-yl)benzonitrile CAS Name: 2-propoxy-5-[3-(4-pyridazinyl)-1H-1,2,4-triazol-5-yl]benzonitrile IUPAC Name: 2-propoxy-5-(3-pyridazin-4-yl-1H-1,2,4-triazol-5-yl)benzonitrile Traditional Name: 2-propoxy-5-(3-pyridazin-4-yl-1H-1,2,4-triazol-5-yl)benzonitrile Formula: C16H14N6O MolecularWeight: 306.32196

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NC(=NN2)C3=CN=NC=C3)C#N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NC(=NN2)C3=CN=NC=C3)C#N

InChI

InChI=1S/C16H14N6O/c1-2-7-23-14-4-3-11(8-13(14)9-17)15-20-16(22-21-15)12-5-6-18-19-10-12/h3-6,8,10H,2,7H2,1H3,(H,20,21,22)